tert-butyl 4-(3-azido-2-oxidanyl-propyl)-3-(tert-butylcarbamoyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-azido-2-oxidanyl-propyl)-3-(tert-butylcarbamoyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(3-azido-2-hydroxy-propyl)-3-(tert-butylcarbamoyl)piperazine-1-carboxylate CAS Name: 4-(3-azido-2-hydroxypropyl)-3-[(tert-butylamino)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-azido-2-hydroxypropyl)-3-(tert-butylcarbamoyl)piperazine-1-carboxylate Traditional Name: 4-(3-azido-2-hydroxy-propyl)-3-(tert-butylcarbamoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C17H32N6O4 MolecularWeight: 384.47378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1CN(CCN1CC(CN=[N+]=[N-])O)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)NC(=O)C1CN(CCN1CC(CN=[N+]=[N-])O)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H32N6O4/c1-16(2,3)20-14(25)13-11-23(15(26)27-17(4,5)6)8-7-22(13)10-12(24)9-19-21-18/h12-13,24H,7-11H2,1-6H3,(H,20,25)